1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-[(1-thiophen-3-ylcarbonylpiperidin-4-yl)methyl]phenyl]urea

Systemtic Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-[(1-thiophen-3-ylcarbonylpiperidin-4-yl)methyl]phenyl]urea Openeye Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[4-[[1-(thiophene-3-carbonyl)-4-piperidyl]methyl]phenyl]urea CAS Name: 1-[5-tert-butyl-2-(4-methylphenyl)-3-pyrazolyl]-3-[4-[[1-[oxo(3-thiophenyl)methyl]-4-piperidinyl]methyl]phenyl]urea IUPAC Name: 1-[5-tert-butyl-2-(4-methylphenyl)pyrazol-3-yl]-3-[4-[[1-(thiophene-3-carbonyl)piperidin-4-yl]methyl]phenyl]urea Traditional Name: 1-[5-tert-butyl-2-(p-tolyl)pyrazol-3-yl]-3-[4-[[1-(3-thenoyl)-4-piperidyl]methyl]phenyl]urea Formula: C32H37N5O2S MolecularWeight: 555.73348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C=C3)CC4CCN(CC4)C(=O)C5=CSC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=CC(=N2)C(C)(C)C)NC(=O)NC3=CC=C(C=C3)CC4CCN(CC4)C(=O)C5=CSC=C5

InChI

InChI=1S/C32H37N5O2S/c1-22-5-11-27(12-6-22)37-29(20-28(35-37)32(2,3)4)34-31(39)33-26-9-7-23(8-10-26)19-24-13-16-36(17-14-24)30(38)25-15-18-40-21-25/h5-12,15,18,20-21,24H,13-14,16-17,19H2,1-4H3,(H2,33,34,39)